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2-Benzamido-3,3,3-trifluoro-2-[(5-methyl-2-phenyl-3-pyrazolyl)amino]propanoic acid methyl ester
SpectraBase Compound ID E89Pq0FRr6U
InChI InChI=1S/C21H19F3N4O3/c1-14-13-17(28(27-14)16-11-7-4-8-12-16)25-20(19(30)31-2,21(22,23)24)26-18(29)15-9-5-3-6-10-15/h3-13,25H,1-2H3,(H,26,29)
InChIKey RTAITQCOZNULGK-UHFFFAOYSA-N
Mol Weight 432.4 g/mol
Molecular Formula C21H19F3N4O3
Exact Mass 432.140925 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ry3dfHdCMR
Name 2-Benzamido-3,3,3-trifluoro-2-[(5-methyl-2-phenyl-3-pyrazolyl)amino]propanoic acid methyl ester
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Formula C21H19F3N4O3
InChI InChI=1S/C21H19F3N4O3/c1-14-13-17(28(27-14)16-11-7-4-8-12-16)25-20(19(30)31-2,21(22,23)24)26-18(29)15-9-5-3-6-10-15/h3-13,25H,1-2H3,(H,26,29)
InChIKey RTAITQCOZNULGK-UHFFFAOYSA-N
Molecular Weight 432.403 g/mol
SMILES N(c1[n](nc(c1)C)-c1ccccc1)C(NC(=O)c1ccccc1)(C(F)(F)F)C(=O)OC
SPLASH splash10-0pdi-6950100000-2b5e2592cb11235630bc
Synonyms 2-Benzamido-3,3,3-trifluoro-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]propionic acid methyl ester Methyl 2-benzamido-3,3,3-trifluoro-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]propanoate Methyl 2-benzamido-3,3,3-tris(fluoranyl)-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]propanoate
Wiley ID 1443758